1-adamantyl-[(2-chloranyl-6-fluoranyl-phenyl)methyl]azanium

Systemtic Name: 1-adamantyl-[(2-chloranyl-6-fluoranyl-phenyl)methyl]azanium Openeye Name: 1-adamantyl-[(2-chloro-6-fluoro-phenyl)methyl]ammonium CAS Name: 1-adamantyl-[(2-chloro-6-fluorophenyl)methyl]ammonium IUPAC Name: 1-adamantyl-[(2-chloro-6-fluorophenyl)methyl]azanium Traditional Name: 1-adamantyl-(2-chloro-6-fluoro-benzyl)ammonium Formula: C17H22ClFN+ MolecularWeight: 294.814683

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C17H21ClFN/c18-15-2-1-3-16(19)14(15)10-20-17-7-11-4-12(8-17)6-13(5-11)9-17/h1-3,11-13,20H,4-10H2/p+1